SCHEMBL5314043

SCHEMBL5314043

O=CC(Oc1ccc(Cl)cc1)N1CCC(O)(Cc2ccc(F)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
CACNA1G O43497 1/20 0.39
KCNH2 Q12809 1/20 0.39
DRD2 P14416 6/20 0.38
DRD3 P35462 3/20 0.38
HRH1 P35367 3/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5317298 0.94 OPRM1 (0.41) PPARGPPARAGRIN2DGRIN3BGRIN1
SCHEMBL3814747 0.78 OPRM1 (0.45) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL5315889 0.73 POLB (0.56) ADRA1AMEN1POLBKMT2AKCNH2
SCHEMBL19691780 0.72 MEN1 (0.33) MEN1POLBKMT2ASLC6A2SLC6A4
SCHEMBL14840627 0.70 OPRM1 (0.43) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL20147416 0.70 OPRM1 (0.50) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL654281 0.69 CYP2D6 (0.49) HTR1ASLC6A2HTR2ASLC6A4HTR7
SCHEMBL652763 0.69 SLC6A2 (0.41) KCNH2HTR1ASLC6A2SLC6A4
SCHEMBL27463353 0.69 GRIN2D (0.48) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL20147864 0.68 OPRM1 (0.48) GRIN2DGRIN3BADRA1DADRA1AADRA1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007073432-A2 PIPERIDINE DERIVATIVES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-06-28 WO disclosed